| SpectraBase Spectrum ID |
GVz7K1E4iwd |
| Name |
Glutaric acid, cyclohexylmethyl 3-methylbut-3-en-1-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.198759378 u |
| Formula |
C17H28O4 |
| InChI |
InChI=1S/C17H28O4/c1-14(2)11-12-20-16(18)9-6-10-17(19)21-13-15-7-4-3-5-8-15/h15H,1,3-13H2,2H3 |
| InChIKey |
MQVBLLADCVWRGD-UHFFFAOYSA-N |
| Molecular Weight |
296.407 g/mol |
| SMILES |
C(CCC(OCC1CCCCC1)=O)C(OCCC(C)=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828496 |
